- InChI
- InChI=1S/C21H38O4/c1-3-5-7-8-9-10-11-15-19-25-21(23)17-13-12-16-20(22)24-18-14-6-4-2/h9-10H,3-8,11-19H2,1-2H3/b10-9+
- InChI Key
- GRJYQNCPDVDRDK-MDZDMXLPSA-N
- Formula
- C21H38O4
- SMILES
-
CCCCCC=CCCCOC(=O)CCCCC(=O)OCCC
CC - Molecular Weight1
- 354.52
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.0044 | Relay (1.0) Calculated Property | |
| ΔfG° | -414.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1028.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 103.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.740 | Crippen Calculated Property | |
| McVol | 317.330 | ml/mol | McGowan Calculated Property |
| Pc | 993.88 | kPa | Joback Calculated Property |
| Inp | 2420.00 | NIST | |
| Tboil | 622.16 | K | Relay (1.0) Calculated Property |
| Tc | 795.23 | K | Relay (1.0) Calculated Property |
| Tfus | 255.80 | K | Relay (1.0) Calculated Property |
| Vc | 1.202 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [987.81; 1081.51] | J/mol×K | [800.68; 983.12] | 
|
| Cp,gas | 987.81 | J/mol×K | 800.68 | Joback Calculated Property |
| Cp,gas | 1006.03 | J/mol×K | 831.09 | Joback Calculated Property |
| Cp,gas | 1023.17 | J/mol×K | 861.49 | Joback Calculated Property |
| Cp,gas | 1039.26 | J/mol×K | 891.90 | Joback Calculated Property |
| Cp,gas | 1054.33 | J/mol×K | 922.31 | Joback Calculated Property |
| Cp,gas | 1068.40 | J/mol×K | 952.72 | Joback Calculated Property |
| Cp,gas | 1081.51 | J/mol×K | 983.12 | Joback Calculated Property |
| η | [0.0000314; 0.0012632] | Pa×s | [406.01; 800.68] |
|
| η | 0.0012632 | Pa×s | 406.01 | Joback Calculated Property |
| η | 0.0004442 | Pa×s | 471.79 | Joback Calculated Property |
| η | 0.0002017 | Pa×s | 537.57 | Joback Calculated Property |
| η | 0.0001088 | Pa×s | 603.34 | Joback Calculated Property |
| η | 0.0000663 | Pa×s | 669.12 | Joback Calculated Property |
| η | 0.0000441 | Pa×s | 734.90 | Joback Calculated Property |
| η | 0.0000314 | Pa×s | 800.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, dec-4-enyl pentyl ester.
Sources
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